P671-2817 Screening compound: N-[2-(4-chlorophenyl)ethyl]-2-[2-(4-fluorophenyl)-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-7-yl]acetamide

P671-2817 Screening compound: N-[2-(4-chlorophenyl)ethyl]-2-[2-(4-fluorophenyl)-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-7-yl]acetamide
P671-2817 Screening compound: N-[2-(4-chlorophenyl)ethyl]-2-[2-(4-fluorophenyl)-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-7-yl]acetamide alternative view

Chemical Structure Depiction of ChemDiv screening compound P671-2817
N-[2-(4-chlorophenyl)ethyl]-2-[2-(4-fluorophenyl)-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-7-yl]acetamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

P671-2817

Molecular Formula

C21H17ClFN5O2 (C21 H17 ClFN5 O2)

Compound Name

N-[2-(4-chlorophenyl)ethyl]-2-[2-(4-fluorophenyl)-4-oxo-4H,5H-pyrazolo[1,5-d][1,2,4]triazin-7-yl]acetamide

IUPAC name

N-[2-(4-chlorophenyl)ethyl]-2-[2-(4-fluorophenyl)-4-oxo-4H5H-pyrazolo[15-d][124]triazin-7-yl]acetamide

SMILES

O=C(CC(n(c1c2)nc2-c(cc2)ccc2F)=NNC1=O)NCCc(cc1)ccc1Cl

InChI

InChI=1S/C21H17ClFN5O2/c22-15-5-1-13(2-6-15)9-10-24-20(29)12-19-25-26-21(30)18-11-17(27-28(18)19)14-3-7-16(23)8-4-14/h1-8,11H,9-10,12H2,(H,24,29)(H,26,30)

InChI Key

WRZKQXMXFGJGBI-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27610930

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

425.85

Hydrogen Bond Acceptors Count

6.00

Hydrogen Bond Donors Count

2.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

2.812

Distribution Coefficient, logD

2.812

Water Solubility, LogSw

-3.71

Polar Surface Area

75.062

Acid Dissociation Constant (pKa)

10.23

Base Dissociation Constant (pKb)

1.01

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

14.30

P671-2817 in Drug Discovery

Included in Screening Libraries

Angiogenesis library (14822 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cancer

References: we are preparing a list of scientific research reports with P671-2817 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound P671-2817?
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What is the minimum amount of P671-2817 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for P671-2817
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for P671-2817
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of P671-2817 available by request